SCHEMBL23458145

SCHEMBL23458145

NC(=O)c1cccc(C(=O)Cc2ccnc(Cl)n2)c1F

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 3/20 0.38
GPR52 Q9Y2T5 7/20 0.35
LMNA P02545 1/20 0.34
CD38 P28907 3/20 0.34
RAB9A P51151 1/20 0.33
KDM4E B2RXH2 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
AURKA O14965 1/20 0.33
RPS6KB1 P23443 1/20 0.33
AURKB Q96GD4 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL23458147 0.87 MAPK13 (0.35) PARP1RAB9A
SCHEMBL31264104 0.86 MRGPRX4 (0.33) PARP1CD38RAB9AKDM4EAURKA
SCHEMBL31443297 0.85 RAB9A (0.33) RAB9A
SCHEMBL31111624 0.84 KMT2A (0.32) LMNARAB9AKDM4EL3MBTL1
SCHEMBL2254723 0.82 TRPV1 (0.40) LMNARAB9AKDM4EL3MBTL1
SCHEMBL3884176 0.81 TRPV1 (0.36) RAB9AKDM4E
SCHEMBL9987868 0.81 MAPK13 (0.39) LMNARAB9AKDM4E
SCHEMBL30605929 0.80 MEN1 (0.37) LMNARAB9AKDM4EAURKAAURKB
SCHEMBL26134079 0.80 MEN1 (0.37) LMNARAB9AKDM4EAURKAAURKB
SCHEMBL24761235 0.79 ERCC5 (0.47) RAB9AL3MBTL1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4069692-A1 N-(3-(5-(PYRIMIDIN-4-YL)THIAZOL-4-YL)PHENYL)SULFONAMIDE COMPOUNDS AND THEIR USES AS BRAF INHIBITORS Institut National de la Santé et de la Recherche Médicale (INSERM) (FR) 2022-10-12 EP disclosed
WO-2021110997-A1 N-(3-(5-(PYRIMIDIN-4-YL)THIAZOL-4-YL)PHENYL)SULFONAMIDE COMPOUNDS AND THEIR USES AS BRAF INHIBITORS INSERM (Institut National de la Santé et de la Recherche Médicale) (FR) 2021-06-10 WO disclosed